@MOLECULE 2-(4-methylphenoxy)ethylphosphinate 25 25 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C 1.5202 0.7548 0.9599 C.ar 1 UNL1 -0.2288 2 C 2.8115 1.1723 0.6687 C.ar 1 UNL1 -0.1221 3 C 3.6375 0.4035 -0.1592 C.ar 1 UNL1 -0.0188 4 C 3.1626 -0.7977 -0.6888 C.ar 1 UNL1 -0.1228 5 C 1.8705 -1.2380 -0.4087 C.ar 1 UNL1 -0.2738 6 C 1.0635 -0.4507 0.4105 C.ar 1 UNL1 0.2324 7 O -0.1990 -0.7766 0.8051 O.3 1 UNL1 -0.3617 8 C -0.9420 -1.6622 -0.0360 C.3 1 UNL1 0.0040 9 C -2.4120 -1.2874 0.2352 C.3 1 UNL1 -0.3131 10 P -2.8144 0.4906 -0.0175 P.3 1 UNL1 0.1327 11 O -2.9658 0.9096 -1.4711 O.2 1 UNL1 -0.2205 12 O -4.2474 0.8403 0.3425 O.3 1 UNL1 -0.2377 13 C 5.0222 0.8564 -0.4765 C.3 1 UNL1 -0.4456 14 H 0.8664 1.3404 1.6005 H 1 UNL1 0.1691 15 H 3.1812 2.1086 1.0853 H 1 UNL1 0.1541 16 H 3.8078 -1.3995 -1.3275 H 1 UNL1 0.1521 17 H 1.5173 -2.1784 -0.8160 H 1 UNL1 0.1590 18 H -0.6452 -1.5665 -1.0984 H 1 UNL1 0.1402 19 H -0.7258 -2.6922 0.3077 H 1 UNL1 0.1275 20 H -3.0823 -1.9175 -0.4178 H 1 UNL1 0.1992 21 H -2.6711 -1.5645 1.3007 H 1 UNL1 0.1972 22 H 5.2044 0.8687 -1.5610 H 1 UNL1 0.1577 23 H 5.2329 1.8688 -0.1069 H 1 UNL1 0.1540 24 H 5.7716 0.1877 -0.0270 H 1 UNL1 0.1585 25 H -1.8074 1.2177 0.7138 H 1 UNL1 0.2073 @BOND 1 22 13 1 2 11 10 2 3 16 4 1 4 18 8 1 5 17 5 1 6 4 5 ar 7 4 3 ar 8 13 3 1 9 13 23 1 10 13 24 1 11 20 9 1 12 5 6 ar 13 3 2 ar 14 8 9 1 15 8 19 1 16 8 7 1 17 10 9 1 18 10 12 1 19 10 25 1 20 9 21 1 21 6 7 1 22 6 1 ar 23 2 1 ar 24 2 15 1 25 1 14 1